methyl 4-oxidanylidene-2-sulfanylidene-3-[(3,4,5-triethoxyphenyl)carbonylamino]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-sulfanylidene-3-[(3,4,5-triethoxyphenyl)carbonylamino]-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-thioxo-3-[(3,4,5-triethoxybenzoyl)amino]-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-3-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]-2-sulfanylidene-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-sulfanylidene-3-[(3,4,5-triethoxybenzoyl)amino]-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-thioxo-3-[(3,4,5-triethoxybenzoyl)amino]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C23H25N3O7S MolecularWeight: 487.5255

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NN2C(=O)C3=C(C=C(C=C3)C(=O)OC)NC2=S

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NN2C(=O)C3=C(C=C(C=C3)C(=O)OC)NC2=S

InChI

InChI=1S/C23H25N3O7S/c1-5-31-17-11-14(12-18(32-6-2)19(17)33-7-3)20(27)25-26-21(28)15-9-8-13(22(29)30-4)10-16(15)24-23(26)34/h8-12H,5-7H2,1-4H3,(H,24,34)(H,25,27)